2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine

C15H23N — CID 43081283

IUPAC2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine
SMILESCc1ccccc1CNC1CCCCC1C
InChIInChI=1S/C15H23N/c1-12-7-3-5-9-14(12)11-16-15-10-6-4-8-13(15)2/h3,5,7,9,13,15-16H,4,6,8,10-11H2,1-2H3
InChIKeyAIMFWKCQCGOFCX-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.66
Rot. Bonds3

About 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine

2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine (PubChem CID 43081283) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine
PubChem CID43081283
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine
SMILESCc1ccccc1CNC1CCCCC1C
InChIInChI=1S/C15H23N/c1-12-7-3-5-9-14(12)11-16-15-10-6-4-8-13(15)2/h3,5,7,9,13,15-16H,4,6,8,10-11H2,1-2H3
InChIKeyAIMFWKCQCGOFCX-UHFFFAOYSA-N
XLogP3.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine (CID 43081283) is 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine is Cc1ccccc1CNC1CCCCC1C.
What is the InChIKey of 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine?
The InChIKey is AIMFWKCQCGOFCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12-7-3-5-9-14(12)11-16-15-10-6-4-8-13(15)2/h3,5,7,9,13,15-16H,4,6,8,10-11H2,1-2H3.
What are the key properties of 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine?
2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 43081283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).